[Ifeffit] Quick first shell fit - Artemis

Karin Julius karin.julius at tu-dortmund.de
Wed Jul 30 08:04:43 CDT 2014


Hello,

I'm trying to do a quick first shell fit with Artemis for my EXAFS
measurement of 0.1 M auqeous solution of RbCl.
I'm especially interested in the first hydration shell of the Rb ion.
So I made an atoms input file with Rb and O in Rock salt structure. But
how do I consider the Cl ion in the quick first shell fit? I don't think I
can overlook the scattering on the Cl ions.


Best regards, Karin





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